Basic information
- CAS
6636-13-1- Standard SMILES
CCN(CC)CCNS(=O)(=O)c1ccc(C)cc1- InChIKey
UDVZDSBQHHMVLW-UHFFFAOYSA-N- Molecular formula
- C13H22N2O2S
- Average molar mass
- 270.39 g/mol
- Monoisotopic mass
- 270.14019912
Names & identifiers
- Preferred name
- p-Toluenesulfonamide, N-(2-diethylaminoethyl)-
- IUPAC
- N-[2-(diethylamino)ethyl]-4-methylbenzenesulfonamide
- English name
- N-[2-(Diethylamino)ethyl]-4-methylbenzene-1-sulfonamide
- Molecular formula
- C13H22N2O2S
- Molecular weight
- 270.39
Names & synonyms
6636-13-1p-Toluenesulfonamide, N-(2-diethylaminoethyl)-NSC 16455BRN 3034254N-(2-Diethylaminoethyl)-p-toluenesulfonamideDTXSID002165834-11-00-00439 (Beilstein Handbook Reference)RefChem:367769DTXCID30139074p-Toluenesulfonamide, N-[2-(diethylamino)ethyl]-N-[2-(diethylamino)ethyl]-4-methylbenzenesulfonamideCHEMBL3087796
Show more names
NSC-16455NSC164555GPH6T68RVN-[2-(diethylamino)ethyl]-4-methylbenzene-1-sulfonamideBDBM50443040STK083886AKOS005393050Benzenesulfonamide, N-[2-(diethylamino)ethyl]-4-methyl-
Database identifiers
- CAS
6636-13-1- PubChem CID
- 95080
- DTXSID
DTXSID00216583- ChEMBL
CHEMBL3087796- UNII
- 5GPH6T68RV
- Nikkaji
- J48.044D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Chemistry & industry
Suppliers1 total
VITAS-BB—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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